CID 498851

Nsc635811

Structural Information

Molecular Formula
C5H9Cl3O2Te
SMILES
CCCC(C=O)O[Te](Cl)(Cl)Cl
InChI
InChI=1S/C5H9Cl3O2Te/c1-2-3-5(4-9)10-11(6,7)8/h4-5H,2-3H2,1H3
InChIKey
UYABMROFTJJLCR-UHFFFAOYSA-N
Compound name
2-(trichloro-lambda4-tellanyl)oxypentanal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.87305 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.88033 161.8
[M+Na]+ 358.86227 169.6
[M-H]- 334.86577 160.0
[M+NH4]+ 353.90687 180.3
[M+K]+ 374.83621 164.8
[M+H-H2O]+ 318.87031 159.0
[M+HCOO]- 380.87125 167.6
[M+CH3COO]- 394.88690 190.0
[M+Na-2H]- 356.84772 163.9
[M]+ 335.87250 166.6
[M]- 335.87360 166.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.